methyl 4-(3-methyl-4-naphthalen-2-ylsulfonyl-piperazin-1-yl)carbonyl-2-phenyl-6-propan-2-yl-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-(3-methyl-4-naphthalen-2-ylsulfonyl-piperazin-1-yl)carbonyl-2-phenyl-6-propan-2-yl-pyrimidine-5-carboxylate Openeye Name: methyl 4-isopropyl-6-[3-methyl-4-(2-naphthylsulfonyl)piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[[3-methyl-4-(2-naphthalenylsulfonyl)-1-piperazinyl]-oxomethyl]-2-phenyl-6-propan-2-yl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-methyl-4-naphthalen-2-ylsulfonylpiperazine-1-carbonyl)-2-phenyl-6-propan-2-ylpyrimidine-5-carboxylate Traditional Name: 4-isopropyl-6-[3-methyl-4-(2-naphthylsulfonyl)piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylic acid methyl ester Formula: C31H32N4O5S MolecularWeight: 572.67458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C4=C(C(=NC(=N4)C5=CC=CC=C5)C(C)C)C(=O)OC

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C4=C(C(=NC(=N4)C5=CC=CC=C5)C(C)C)C(=O)OC

InChI

InChI=1S/C31H32N4O5S/c1-20(2)27-26(31(37)40-4)28(33-29(32-27)23-11-6-5-7-12-23)30(36)34-16-17-35(21(3)19-34)41(38,39)25-15-14-22-10-8-9-13-24(22)18-25/h5-15,18,20-21H,16-17,19H2,1-4H3